(2,2,6,6-tetramethylpiperidin-1-ium-4-yl) 2-cyanoethanoate

Systemtic Name: (2,2,6,6-tetramethylpiperidin-1-ium-4-yl) 2-cyanoethanoate Openeye Name: (2,2,6,6-tetramethylpiperidin-1-ium-4-yl) 2-cyanoacetate CAS Name: 2-cyanoacetic acid (2,2,6,6-tetramethyl-4-piperidin-1-iumyl) ester IUPAC Name: (2,2,6,6-tetramethylpiperidin-1-ium-4-yl) 2-cyanoacetate Traditional Name: 2-cyanoacetic acid (2,2,6,6-tetramethylpiperidin-1-ium-4-yl) ester Formula: C12H21N2O2+ MolecularWeight: 225.30734

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)OC(=O)CC#N)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)OC(=O)CC#N)C

InChI

InChI=1S/C12H20N2O2/c1-11(2)7-9(8-12(3,4)14-11)16-10(15)5-6-13/h9,14H,5,7-8H2,1-4H3/p+1